8525-0159 Screening compound: 6-METHOXY-2-(4-METHYLBENZOYL)-2

8525-0159 Screening compound: 6-METHOXY-2-(4-METHYLBENZOYL)-2
8525-0159 Screening compound: 6-METHOXY-2-(4-METHYLBENZOYL)-2 alternative view

Chemical Structure Depiction of ChemDiv screening compound 8525-0159
6-METHOXY-2-(4-METHYLBENZOYL)-2

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8525-0159

Molecular Formula

C27H23N3O3 (C27 H23 N3 O3)

Compound Name

6-METHOXY-2-(4-METHYLBENZOYL)-2

IUPAC name

n/a

SMILES

Cc(cc1)ccc1C(N(CCc1c2[nH]c(cc3)c1cc3OC)C2(c(cccc1)c1N1)C1=O)=O

InChI

InChI=1S/C27H23N3O3/c1-16-7-9-17(10-8-16)25(31)30-14-13-19-20-15-18(33-2)11-12-22(20)28-24(19)27(30)21-5-3-4-6-23(21)29-26(27)32/h3-12,15,28H,13-14H2,1-2H3,(H,29,32)/t27-/m0/s1

InChI Key

ABZYUACNUMIIIB-MHZLTWQESA-N

MDL Number (MFCD)

MFCD08075622

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.683

Distribution Coefficient, logD

4.683

Water Solubility, LogSw

-4.37

Polar Surface Area

58.293

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

6.00

8525-0159 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Antiviral HBV Library (10007 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Spiro Library (21655 compounds)

Targeted Diversity Library (40567 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Targets:
  • Proteases
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 8525-0159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8525-0159?
Check Price and Availability of 8525-0159, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8525-0159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8525-0159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8525-0159
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8525-0159 available by request